AttributeError: 'PyNEPCalculator' object has no attribute 'relax_calc'

Open lnnbig opened this issue 9 months ago • 0 comments

I ran the "07--2-Na-NEP" example using the offline version of MAGUS-2.0.3 (link) and installed NEP using: pip install git+https://github.com/bigd4/PyNEP.git. However, I encountered the following error:

Would you like help diagnosing the cause of this error?

Apr 30 '25 01:04 lnnbig